Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3qrb_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 4.A N GLU 93.A O no hydrogen 2.888 N/A ILE 7.A N VAL 95.A O no hydrogen 2.925 N/A CYS 9.A N THR 97.A O no hydrogen 2.927 N/A CYS 9.A SG.A PRO 10.A O no hydrogen 3.758 N/A CYS 9.A SG.A GLU 13.A OE1 no hydrogen 3.401 N/A CYS 9.A SG.B SER 8.A O no hydrogen 3.404 N/A GLU 11.A N THR 99.A O no hydrogen 2.957 N/A ASN 12.A N LEU 66.A O no hydrogen 2.998 N/A ASN 12.A ND2 ASP 103.A OD2 no hydrogen 2.890 N/A LYS 14.A NZ ASN 12.A O no hydrogen 2.972 N/A LYS 19.A N VAL 62.A O no hydrogen 2.832 N/A LYS 19.A NZ LYS 14.A O no hydrogen 2.845 N/A LYS 19.A NZ GLU 16.A O no hydrogen 2.770 N/A LEU 21.A N LEU 60.A O no hydrogen 2.770 N/A VAL 22.A N LEU 60.A O no hydrogen 3.498 N/A GLN 23.A NE2 THR 57.A O no hydrogen 2.854 N/A ILE 24.A N GLY 58.A O no hydrogen 2.983 N/A SER 26.A N TYR 36.A OH no hydrogen 2.869 N/A SER 26.A OG GLU 89.A OE2 no hydrogen 2.574 N/A ARG 28.A N SER 26.A OG no hydrogen 2.990 N/A ARG 28.A NE GLU 31.A OE1 no hydrogen 3.279 N/A ARG 28.A NE GLU 31.A OE2 no hydrogen 3.507 N/A ARG 28.A NH1 VAL 88.A O no hydrogen 3.062 N/A ARG 28.A NH2 GLU 31.A OE1 no hydrogen 3.341 N/A ASP 29.A N SER 26.A O no hydrogen 3.241 N/A GLU 31.A N ARG 28.A O no hydrogen 2.948 N/A THR 32.A N ARG 28.A O no hydrogen 3.426 N/A THR 32.A OG1.A LYS 33.A O no hydrogen 3.276 N/A LYS 33.A NZ GLU 56.A OE1 no hydrogen 2.572 N/A PHE 35.A N VAL 81.A O no hydrogen 2.740 N/A TYR 36.A N ARG 55.A O no hydrogen 2.812 N/A SER 37.A N HIS 79.A O no hydrogen 3.154 N/A THR 39.A N TYR 77.A O no hydrogen 2.894 N/A THR 39.A OG1 HIS 79.A NE2 no hydrogen 2.856 N/A GLY 40.A N ASP 44.A OD1 no hydrogen 2.782 N/A GLY 42.A N LYS 45.A O no hydrogen 2.930 N/A ALA 43.A N GLY 40.A O no hydrogen 2.896 N/A LYS 45.A N GLY 40.A O no hydrogen 3.132 N/A GLY 49.A N ALA 43.A O no hydrogen 2.806 N/A PHE 51.A N GLY 42.A O no hydrogen 2.804 N/A ILE 52.A N LYS 61.A O no hydrogen 3.034 N/A GLU 54.A N TRP 59.A O no hydrogen 2.878 N/A GLU 56.A N GLU 54.A OE1.B no hydrogen 2.670 N/A THR 57.A N GLU 54.A OE1.B no hydrogen 2.747 N/A THR 57.A OG1 GLU 54.A OE1.A no hydrogen 2.497 N/A THR 57.A OG1 GLU 54.A OE1.B no hydrogen 3.474 N/A GLY 58.A N GLU 54.A O no hydrogen 2.943 N/A TRP 59.A N THR 57.A OG1 no hydrogen 3.195 N/A LEU 60.A N VAL 22.A O no hydrogen 2.788 N/A LYS 61.A N ILE 52.A O no hydrogen 2.760 N/A LYS 61.A NZ GLU 54.A OE2.A no hydrogen 2.373 N/A VAL 62.A N LYS 19.A O no hydrogen 2.891 N/A THR 63.A N VAL 50.A O no hydrogen 2.852 N/A THR 63.A OG1 GLY 49.A O no hydrogen 2.681 N/A THR 63.A OG1 VAL 50.A O no hydrogen 3.163 N/A ARG 68.A N GLU 11.A OE1 no hydrogen 2.924 N/A ARG 68.A NE GLU 69.A OE2 no hydrogen 3.083 N/A ARG 68.A NE ASP 100.A OD1 no hydrogen 2.918 N/A ARG 68.A NH2 GLU 69.A OE2 no hydrogen 2.904 N/A GLU 69.A N ASP 67.A OD1 no hydrogen 3.052 N/A ALA 70.A N ASP 67.A O no hydrogen 3.031 N/A ILE 71.A N ASP 67.A O no hydrogen 3.020 N/A TYR 74.A N ILE 96.A O no hydrogen 2.896 N/A LEU 76.A N ILE 94.A O no hydrogen 2.825 N/A TYR 77.A N THR 39.A O no hydrogen 2.915 N/A SER 78.A N MET 92.A O no hydrogen 2.925 N/A SER 78.A OG MET 92.A O no hydrogen 3.538 N/A HIS 79.A N SER 37.A O no hydrogen 2.818 N/A HIS 79.A NE2 THR 39.A OG1 no hydrogen 2.856 N/A VAL 81.A N PHE 35.A O no hydrogen 2.906 N/A SER 82.A N GLU 86.A O no hydrogen 2.826 N/A SER 82.A OG ASN 84.A OD1.B no hydrogen 2.144 N/A SER 82.A OG GLU 86.A O no hydrogen 3.410 N/A SER 83.A N LYS 33.A O no hydrogen 3.010 N/A GLY 85.A N SER 82.A O no hydrogen 2.873 N/A GLU 86.A N SER 82.A OG no hydrogen 3.134 N/A GLU 86.A N ASN 84.A OD1.B no hydrogen 3.298 N/A VAL 88.A N ALA 80.A O no hydrogen 2.801 N/A MET 92.A N SER 78.A O no hydrogen 3.075 N/A ILE 94.A N LEU 76.A O no hydrogen 2.783 N/A VAL 95.A N ILE 4.A O no hydrogen 2.790 N/A ILE 96.A N TYR 74.A O no hydrogen 2.908 N/A THR 97.A N ILE 7.A O no hydrogen 2.979 N/A VAL 98.A N ALA 72.A O no hydrogen 2.887 N/A THR 99.A N CYS 9.A O no hydrogen 2.903 N/A GLN 101.A N GLU 11.A OE2 no hydrogen 2.838 N/A ASN 102.A ND2 ASP 195.A OD1 no hydrogen 3.040 N/A ASN 102.A ND2 ASP 195.A OD2 no hydrogen 3.255 N/A ASN 104.A N ASP 136.A OD2 no hydrogen 3.033 N/A ASN 104.A ND2 ASP 136.A OD1 no hydrogen 3.034 N/A ARG 105.A NH1 SER 202.A O no hydrogen 2.862 N/A GLU 107.A N THR 133.A O no hydrogen 2.837 N/A THR 109.A N SER 131.A O no hydrogen 2.950 N/A THR 109.A OG1 SER 131.A O no hydrogen 3.349 N/A THR 109.A OG1 SER 131.A OG.B no hydrogen 2.771 N/A PHE 113.A N LYS 206.A O no hydrogen 2.819 N/A GLY 115.A N VAL 208.A O no hydrogen 3.013 N/A VAL 117.A N THR 210.A O no hydrogen 3.027 N/A GLU 119.A N LYS 212.A O no hydrogen 2.770 N/A ALA 121.A N ALA 118.A O no hydrogen 2.931 N/A GLY 124.A N VAL 174.A O no hydrogen 2.676 N/A THR 125.A N VAL 122.A O no hydrogen 3.065 N/A THR 125.A OG1 VAL 122.A O no hydrogen 2.715 N/A SER 126.A OG SER 173.A OG no hydrogen 3.389 N/A VAL 127.A N ILE 172.A O no hydrogen 2.692 N/A MET 128.A N ILE 172.A O no hydrogen 3.379 N/A LYS 129.A NZ VAL 130.A O no hydrogen 3.212 N/A LYS 129.A NZ SER 131.A OG.A no hydrogen 2.908 N/A LYS 129.A NZ THR 169.A O no hydrogen 2.697 N/A VAL 130.A N GLY 170.A O no hydrogen 2.944 N/A SER 131.A OG.B THR 109.A OG1 no hydrogen 2.771 N/A ALA 132.A N TYR 148.A OH no hydrogen 2.854 N/A THR 133.A N GLU 107.A O no hydrogen 2.891 N/A THR 133.A OG1 GLU 107.A O no hydrogen 3.529 N/A ASP 136.A N ASP 134.A OD1 no hydrogen 2.938 N/A ASP 137.A N ASP 100.A OD2 no hydrogen 2.946 N/A VAL 139.A N ASP 137.A OD1 no hydrogen 3.003 N/A ASN 140.A N ASP 137.A OD1 no hydrogen 3.074 N/A ASN 140.A ND2 ASP 137.A OD2 no hydrogen 2.824 N/A THR 141.A OG1 ASP 137.A O no hydrogen 2.685 N/A ASN 143.A N THR 141.A OG1 no hydrogen 2.811 N/A ALA 145.A N TYR 142.A O no hydrogen 3.105 N/A ALA 147.A N ALA 194.A O no hydrogen 2.888 N/A TYR 148.A N ARG 167.A O no hydrogen 2.826 N/A THR 149.A N GLN 192.A O no hydrogen 2.989 N/A VAL 151.A N VAL 190.A O no hydrogen 2.772 N/A SER 152.A N VAL 190.A O no hydrogen 3.445 N/A GLN 153.A NE2 PRO 155.A O no hydrogen 2.819 N/A GLN 153.A NE2 HIS 159.A O no hydrogen 2.912 N/A ASP 154.A N THR 188.A O no hydrogen 2.847 N/A LYS 160.A NZ GLU 156.A OE2 no hydrogen 3.283 N/A MET 162.A N GLN 153.A OE1 no hydrogen 2.787 N/A THR 164.A N SER 173.A O no hydrogen 2.895 N/A ASN 166.A N VAL 171.A O no hydrogen 2.758 N/A ARG 167.A NH2 GLN 197.A O no hydrogen 2.759 N/A ASP 168.A N ASN 166.A OD1 no hydrogen 2.819 N/A THR 169.A N ASN 166.A OD1 no hydrogen 2.942 N/A GLY 170.A N ASN 166.A O no hydrogen 2.935 N/A VAL 171.A N THR 169.A OG1 no hydrogen 3.272 N/A ILE 172.A N MET 128.A O no hydrogen 2.817 N/A SER 173.A N THR 164.A O no hydrogen 2.869 N/A SER 173.A OG SER 126.A OG no hydrogen 3.389 N/A VAL 174.A N THR 125.A O no hydrogen 2.835 N/A LEU 175.A N MET 162.A O no hydrogen 2.723 N/A ARG 181.A N GLU 119.A OE1 no hydrogen 2.801 N/A SER 183.A N ASP 180.A O no hydrogen 3.072 N/A SER 183.A N ASP 180.A OD2 no hydrogen 3.025 N/A SER 183.A OG ASP 180.A OD2 no hydrogen 2.921 N/A TYR 184.A N ASP 180.A O no hydrogen 2.960 N/A TYR 187.A N ILE 209.A O no hydrogen 2.846 N/A TYR 187.A OH LEU 157.A O no hydrogen 2.520 N/A THR 188.A N ASP 154.A O no hydrogen 2.800 N/A LEU 189.A N ALA 207.A O no hydrogen 2.795 N/A VAL 190.A N SER 152.A O no hydrogen 2.992 N/A VAL 191.A N ALA 205.A O no hydrogen 2.854 N/A GLN 192.A N THR 149.A O no hydrogen 2.875 N/A ALA 193.A N THR 203.A O no hydrogen 2.929 N/A ALA 194.A N ALA 147.A O no hydrogen 3.065 N/A ASP 195.A N LEU 201.A O no hydrogen 2.985 N/A LEU 196.A N TYR 142.A O no hydrogen 3.137 N/A GLN 197.A N ALA 145.A O no hydrogen 2.889 N/A GLY 198.A N ASP 195.A O no hydrogen 2.944 N/A GLU 199.A N LEU 196.A O no hydrogen 3.026 N/A GLY 200.A N ASP 195.A O no hydrogen 2.806 N/A LEU 201.A N ASP 195.A OD1 no hydrogen 2.820 N/A THR 203.A N ALA 193.A O no hydrogen 2.962 N/A ALA 205.A N VAL 191.A O no hydrogen 2.928 N/A LYS 206.A N GLU 111.A O no hydrogen 3.024 N/A ALA 207.A N LEU 189.A O no hydrogen 2.802 N/A VAL 208.A N PHE 113.A O no hydrogen 2.819 N/A ILE 209.A N TYR 187.A O no hydrogen 2.805 N/A THR 210.A N GLY 115.A O no hydrogen 2.931 N/A VAL 211.A N PRO 185.A O no hydrogen 2.749 N/A LYS 212.A N VAL 117.A O no hydrogen 2.853 N/A LYS 212.A NZ SER 116.A OG no hydrogen 3.220 N/A